D05KBP 05171100322D 1 1.00000 0.00000 0 28 31 0 1 0 999 V2000 0.4759 3.4246 0.0000 C 0 0 0 0 0 0 0 0 0 1.1843 3.4246 0.0000 C 0 0 0 0 0 0 0 0 0 1.4036 2.7530 0.0000 C 0 0 0 0 0 0 0 0 0 0.8301 2.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0.2567 2.7530 0.0000 C 0 0 3 0 0 0 0 0 0 -1.8764 -1.2439 0.0000 C 0 0 2 0 0 0 0 0 0 -1.2629 -1.5981 0.0000 O 0 0 0 0 0 0 0 0 0 -3.1981 -1.5981 0.0000 O 0 0 0 0 0 0 0 0 0 -2.5847 -1.2439 0.0000 C 0 0 2 0 0 0 0 0 0 -1.6571 -0.5723 0.0000 C 0 0 2 0 0 0 0 0 0 -1.6395 0.4069 0.0000 N 0 0 3 0 0 0 0 0 0 -4.0308 -0.5723 0.0000 O 0 0 0 0 0 0 0 0 0 -2.8039 -0.5723 0.0000 C 0 0 1 0 0 0 0 0 0 -3.4224 -0.2140 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2305 -0.1522 0.0000 O 0 0 0 0 0 0 0 0 0 -0.3503 0.2681 0.0000 N 0 0 0 0 0 0 0 0 0 0.2620 0.6231 0.0000 C 0 0 0 0 0 0 0 0 0 0.2591 1.3370 0.0000 N 0 0 0 0 0 0 0 0 0 -0.3521 1.6878 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6344 1.5525 0.0000 N 0 0 0 0 0 0 0 0 0 -2.0531 0.9816 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9651 0.6227 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9619 1.3308 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3551 2.3961 0.0000 N 0 0 0 0 0 0 0 0 0 -1.0458 -0.9250 0.0000 H 0 0 0 0 0 0 0 0 0 -4.6473 -0.2235 0.0000 N 0 3 0 0 0 0 0 0 0 -5.2576 -0.5830 0.0000 O 0 5 0 0 0 0 0 0 0 -4.6535 0.4848 0.0000 O 0 0 0 0 0 0 0 0 0 6 10 1 0 0 0 10 15 1 0 0 0 15 13 1 0 0 0 13 9 1 0 0 0 6 7 1 6 0 0 22 16 1 0 0 0 1 2 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 9 8 1 6 0 0 18 19 2 0 0 0 19 23 1 0 0 0 22 23 2 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 21 11 1 0 0 0 10 11 1 0 0 0 4 5 1 0 0 0 20 21 2 0 0 0 11 22 1 0 0 0 23 20 1 0 0 0 12 14 1 0 0 0 19 24 1 0 0 0 5 1 1 0 0 0 10 25 1 6 0 0 12 26 1 0 0 0 13 14 1 1 0 0 26 27 1 0 0 0 9 6 1 0 0 0 26 28 2 0 0 0 24 5 1 0 0 0 M CHG 2 26 1 27 -1 M END $$$$